The slow but steady rise of binding free energy calculations in drug discovery.
- Published in:
- Journal of Computer-Aided Molecular Design, 2023, v. 37, n. 2, p. 67, doi. 10.1007/s10822-022-00494-x
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- Publication type:
- Article
Works matching IS 0920654X AND DT 2023 AND VI 37 AND IP 2
Results: 4
1
2
DeepCubist: Molecular Generator for Designing Peptidomimetics based on Complex three-dimensional scaffolds.
- Published in:
- Journal of Computer-Aided Molecular Design, 2023, v. 37, n. 2, p. 107, doi. 10.1007/s10822-022-00493-y
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- Article
3
Computational investigation of functional water molecules in GPCRs bound to G protein or arrestin.
- Published in:
- Journal of Computer-Aided Molecular Design, 2023, v. 37, n. 2, p. 91, doi. 10.1007/s10822-022-00492-z
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- Publication type:
- Article
4
A combined ligand and target-based virtual screening strategy to repurpose drugs as putrescine uptake inhibitors with trypanocidal activity.
- Published in:
- Journal of Computer-Aided Molecular Design, 2023, v. 37, n. 2, p. 75, doi. 10.1007/s10822-022-00491-0
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- Publication type:
- Article